Geometry & MOs

Info

ID:	67161
PubChem CID:	46505982
Reduced:	NOC15H19 (2)
Stoich.:	ABC15D19 (2)
Weight, g/mol:	532.283826
ΔH_f, kcal/mol:	-75.73
Dipole, Da:	3.06
IP(EA), eV:	-9.22(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-adamantyl)-N-[3-(1H-indol-3-yl)-1-oxo-1-(pyridin-3-ylmethylamino)propan-2-yl]benzamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N(C)CC1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

DOS

IR

Vibrations